Hybrid Graph–Machine Learning Framework for Accurate and Interpretable Band Gap Prediction

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Aydın A., Eryılmaz Ü. K., Alkan O. B., Kocagöz P., Ekinci F., Güzel M. S.

JOURNAL OF CHEMICAL INFORMATION AND MODELING, vol.3, pp.1-19, 2026 (SCI-Expanded, Scopus)

• Publication Type: Article / Article
• Volume: 3
• Publication Date: 2026
• Doi Number: 10.1021/acs.jcim.6c00365
• Journal Name: JOURNAL OF CHEMICAL INFORMATION AND MODELING
• Journal Indexes: Scopus, Science Citation Index Expanded (SCI-EXPANDED), Compendex, MEDLINE
• Page Numbers: pp.1-19
• Open Archive Collection: AVESIS Open Access Collection
• Ankara University Affiliated: Yes

Abstract